SCHEMBL22018914

SCHEMBL22018914

CCn1c(SCC(=O)NC2=CC=CCC2)nnc1-c1cnc(F)cc1F

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.44
MAPT P10636 3/20 0.44
ALDH1A1 P00352 5/20 0.42
KMT2A Q03164 3/20 0.42
FPR1 P21462 1/20 0.41
TP53 P04637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13831676 0.80 LMNA (0.62) LMNAMAPTALDH1A1KMT2ATP53
SCHEMBL13831967 0.80 NPSR1 (0.56) LMNAMAPTALDH1A1KMT2ATP53
SCHEMBL22019358 0.79 KMT2A (0.45) LMNAMAPTALDH1A1KMT2ATP53
SCHEMBL22019363 0.78 ALDH1A1 (0.49) LMNAMAPTALDH1A1KMT2ATP53
SCHEMBL22018910 0.76 ALDH1A1 (0.46) LMNAMAPTALDH1A1KMT2AMEN1
SCHEMBL22019616 0.76 ALDH1A1 (0.45) LMNAMAPTALDH1A1KMT2ATP53
SCHEMBL22018795 0.75 KMT2A (0.53) LMNAMAPTALDH1A1KMT2ATP53
SCHEMBL13831348 0.73 NPSR1 (0.56) LMNAMAPTALDH1A1KMT2ATP53
SCHEMBL15983252 0.71 ALDH1A1 (0.55) LMNAMAPTALDH1A1KMT2ANPSR1
SCHEMBL13831673 0.69 SMN1; SMN2 (0.50) LMNAMAPTALDH1A1KMT2AMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3653054-A1 COMPOSITION FOR INHIBITION OF INSECT SENSING Vanderbilt University (US) 2020-05-20 EP disclosed